2-Chloro-3-methyl-4-nitro-6-(prop-2-en-1-yl)phenol

Base Information

Chemical Name:2-Chloro-3-methyl-4-nitro-6-(prop-2-en-1-yl)phenol
CAS No.:88062-29-7
Molecular Formula:C₁₀H₁₀ClNO₃
Molecular Weight:227.647
Hs Code.:
DSSTox Substance ID:DTXSID30521950
Wikidata:Q82386815

Synonyms:88062-29-7;2-Chloro-3-methyl-4-nitro-6-(prop-2-en-1-yl)phenol;DTXSID30521950

Suppliers and Price of 2-Chloro-3-methyl-4-nitro-6-(prop-2-en-1-yl)phenol

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

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Total 0 raw suppliers

Chemical Property of 2-Chloro-3-methyl-4-nitro-6-(prop-2-en-1-yl)phenol

Chemical Property:

XLogP3:3.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:227.0349209
Heavy Atom Count:15
Complexity:254

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=C(C=C(C(=C1Cl)O)CC=C)[N+](=O)[O-]

Technology Process of 2-Chloro-3-methyl-4-nitro-6-(prop-2-en-1-yl)phenol

There total 2 articles about 2-Chloro-3-methyl-4-nitro-6-(prop-2-en-1-yl)phenol which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 52.0%

: 88062-28-6
2-chloro-6-nitro-3-(propenyloxy)toluene

: 88062-29-7
2-chloro-3-hydroxy-6-nitro-4-propenyltoluene

Guidance literature:: In diphenylether; at 225 - 230 ℃; for 1h;
DOI:10.1002/jhet.5570200443

Reference yield:

: 88062-27-5
2-Chlor-3-methyl-4-nitrophenol

: 88062-29-7
2-chloro-3-hydroxy-6-nitro-4-propenyltoluene

Guidance literature:: Multi-step reaction with 2 steps

1: 91 percent / NaHCO₃ / dimethylformamide / 12 h / 60 °C

2: 52 percent / diphenyl ether / 1 h / 225 - 230 °C

With sodium hydrogencarbonate; In diphenylether; N,N-dimethyl-formamide;
DOI:10.1002/jhet.5570200443

Reference yield:

: 88062-29-7
2-chloro-3-hydroxy-6-nitro-4-propenyltoluene

: 88062-26-4
8-chloro-3,5-dihydro-5-phenyl-2H-furo<2,3-f>indole-2-carboxylic acid methyl ester

Guidance literature:: Multi-step reaction with 6 steps

1: 72 percent / 85percent m-chloroperoxybenzoic acid / CH₂Cl₂ / 20 h / Ambient temperature

2: 41 percent / Jones reagent / acetone / 2 h

3: 95 percent / conc. H₂SO₄ / 1,2-dichloro-ethane / 1.5 h / Heating

4: dimethylformamide / 9 h / 160 - 163 °C

5: Fe powder / ethanol; acetic acid / 0.5 h / 80 - 85 °C

6: 68 percent / Cu₂Br₂, Na₂CO₃ / various solvent(s) / 5.5 h / 170 °C

With copper(I) bromide; jones reagent; sulfuric acid; iron; sodium carbonate; 3-chloro-benzenecarboperoxoic acid; In ethanol; dichloromethane; acetic acid; 1,2-dichloro-ethane; N,N-dimethyl-formamide; acetone;
DOI:10.1002/jhet.5570200443